SCHEMBL24486419

SCHEMBL24486419

C=C(C)C1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC6OC[C@H](O)[C@H](O)[C@H]6O[C@]6(O)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]12

nearest known ligand 0.88

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PC P11498 7/20 0.88
F3 P13726 3/20 0.60
XDH P47989 1/20 0.53
GLS O94925 1/20 0.49
PTGS1 P23219 3/20 0.48
PTGS2 P35354 3/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30543004 0.94 PC (1.00) PCF3XDHGLSPTGS1
SCHEMBL25817580 0.94 PC (1.00) PCF3XDHGLSPTGS1
SCHEMBL25993869 0.94 PC (1.00) PCF3XDHGLSPTGS1
SCHEMBL23983782 0.94 PC (1.00) PCF3XDHGLSPTGS1
SCHEMBL22567668 0.94 PC (1.00) PCF3XDHGLSPTGS1
SCHEMBL23983781 0.94 PC (1.00) PCF3XDHGLSPTGS1
SCHEMBL22145063 0.91 PC (0.73) PCF3XDHPTGS1PTGS2
SCHEMBL25817542 0.91 PC (0.95) PCF3XDHGLSPTGS1
SCHEMBL31256542 0.90 PC (0.92) PCF3XDHGLSPTGS1
SCHEMBL25993944 0.89 PC (0.88) PCF3XDHPTGS1PTGS2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11351184-B2 Preparation of Pulsatilla saponin B4 for injection LIU QI (CN) 2022-06-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11351184-B2 Preparation of Pulsatilla saponin B4 for injection ATP6V1B1, VIP, F5 PC 1523/4885F3 58/4885XDH 3172/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.